XLJ.frcmod

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MASS

BOND

ANGLE

DIHE
ca-ca-cc-c3   1    0.600       180.000           2.000      same as ca-ca-ce-c3, penalty score=136.0
ca-ca-cc-cd   1    0.585       180.000           2.000      same as ca-ca-ce-c2, penalty score=223.0
h1-c3-n8-hn   6    1.800         0.000           3.000      same as X -c3-n3-X , penalty score=  0.0

IMPROPER
c3-ca-cc-cd         1.1          180.0         2.0          Using the default value
cc-h4-cd-na         1.1          180.0         2.0          Same as X -X -ca-ha, penalty score= 67.2 (use general term))
ca-cd-na-hn         1.1          180.0         2.0          Using general improper torsional angle  X- X-na-hn, penalty score=  6.0)
ca-ca-ca-na         1.1          180.0         2.0          Using the default value
ca-ca-ca-ha         1.1          180.0         2.0          Using general improper torsional angle  X- X-ca-ha, penalty score=  6.0)
ca-ca-ca-cc         1.1          180.0         2.0          Using the default value

NONBON